Geometry & MOs

Info

ID:	76996
PubChem CID:	48425684
Reduced:	SN3O4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	374.06413
ΔH_f, kcal/mol:	-166.37
Dipole, Da:	5.16
IP(EA), eV:	-9.7(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromo-4-fluorophenoxy)-N-[2-(diethylamino)-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2CCCC2

DOS

IR

Vibrations